| Group | Gene | SwissprotID | PDB | UniprotID | First_obs_res | Last_obs_res | Length_Unp | Ligand | Ligand_type | Activity_label | Spatial_label | Phe_Glu4_dis | Phe_Lys_dis | Dihedral_label | XDFG φ,ψ |
DFG-Asp φ,ψ |
DFG-Phe φ,ψ |
DFG-Phe χ1,χ2 |
DFG-Gly φ,ψ |
ChelixSaltbr_label | Chelix_label | Lys_Glu_dis | Saltbr_label | LysNZ_GluOE_dis | HRD_label | His φ,ψ | Arg φ,ψ | SNC_label | SNCpymol_label | ActLoop_label | ActLoopNT_label | DFG6_XHRD_dis | ActLoopCT_label | APEtype | APEdihe_label | APEdist_label | APE10_dihe_label | APE10 φ,ψ | APE9_dihe_label | APE9 φ,ψ | APE8_dihe_label | APE8 φ,ψ | APE8_rotamer_label | APE8 χ1 | APE67_label | APE6 φ,ψ | APE7 φ,ψ | APE12_dist_label | APE12_DFG4_dis | APE11_dist_label | APE11_DFG4_dis | APE10_dist_label | APE10_DFG4_dis | APE9_dist_label | APE9_Arg_dis | Chain_mut | Chain_phos | Modified_aa | Method | Resolution | Rvalue | FreeRvalue | Chain_id | ChainLen | Ordered_residues | DomainBreak | ActLoopLength | ActLoopResolvedResidues | ActLoopDisorderedResidues | Kinase_domains_Unp | N_Kinase_domains_Unp | pdb | Kincore_name | hmm | Evalue | Score | hmmbeg | hmmend | hmmlen | XDFGnum | DFGnum | PHEnum | DFG4num | DFG6num | LYSnum | GLUnum | GLU4num | XHRDnum | ARGnum | HRDnum | HRDaspnum | aFaspnum | APEnum | APE6num | APE7num | APE8num | APE9num | APE10num | APE11num | APE12num | Hinge1num | Protein_name |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CMGC | CLK1 | CLK1_HUMAN | 5X8IA | P49759 | 154 | 481 | 484.0 | SQZ:501 | Type1 | Active | DFGin | 7.3534 | 13.9989 | BLAminus | -122.66, 172.48 | 71.45, 69.85 | -89.46, 19.16 | 303.2, 86.95 | -71.61, -17.76 | in-in | in | 8.3789 | Saltbr-in | 2.5421 | HRD-in | -68.32, -52.49 | 79.94, -11.57 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8658 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -131.32, 168.72 | APE9-dihe-na | 74.05, 158.08 | APE8-dihe-in | -81.53, 144.19 | APE8-rot-in | 300.53 | APE67-dihe-in | -65.15, -11.28 | -51.71, -50.28 | APE12-dist-in | 13.0833 | APE11-dist-in | 11.6511 | APE10-dist-in | 7.533 | APE9-dist-in | 3.016 | R432A | None | None | XRAY | 1.902 | 0.168 | 0.206 | A | 346.0 | 328.0 | 0 | 25 | 25 | 0 | [[161, 477]] | 1.0 | 5x8i | CMGC_CLK1_HUMAN | CMGC | 2.7e-93 | 318.4 | 1.0 | 301.0 | 301.0 | 324 | 325 | 326 | 328 | 330 | 191 | 206 | 210 | 285 | 287 | 286 | 288.0 | 361 | 349 | 344 | 343 | 342 | 341 | 340 | 339 | 338 | 242 | Dual specificity protein kinase CLK1 |
| CMGC | CLK1 | CLK1_HUMAN | 5X8IB | P49759 | 155 | 481 | 484.0 | SQZ:501 | Type1 | Active | DFGin | 7.3842 | 13.9802 | BLAminus | -126.45, 170.69 | 71.83, 69.37 | -88.36, 11.76 | 302.43, 89.48 | -69.31, -18.97 | in-in | in | 8.3824 | Saltbr-in | 2.41 | HRD-in | -67.27, -52.41 | 79.09, -12.7 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8887 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -130.02, 169.54 | APE9-dihe-na | 72.76, 157.49 | APE8-dihe-in | -80.25, 143.44 | APE8-rot-in | 301.33 | APE67-dihe-in | -65.52, -10.3 | -49.82, -50.77 | APE12-dist-in | 13.1161 | APE11-dist-in | 11.6767 | APE10-dist-in | 7.4994 | APE9-dist-in | 3.0166 | R432A | None | None | XRAY | 1.902 | 0.168 | 0.206 | B | 346.0 | 327.0 | 0 | 25 | 25 | 0 | [[161, 477]] | 1.0 | 5x8i | CMGC_CLK1_HUMAN | CMGC | 2.7e-93 | 318.4 | 1.0 | 301.0 | 301.0 | 324 | 325 | 326 | 328 | 330 | 191 | 206 | 210 | 285 | 287 | 286 | 288.0 | 361 | 349 | 344 | 343 | 342 | 341 | 340 | 339 | 338 | 242 | Dual specificity protein kinase CLK1 |
| Group | Gene | SwissprotID | PDB | UniprotID | First_obs_res | Last_obs_res | Length_Unp | Ligand | Ligand_type | Activity_label | Spatial_label | Phe_Glu4_dis | Phe_Lys_dis | Dihedral_label | XDFG φ,ψ |
DFG-Asp φ,ψ |
DFG-Phe φ,ψ |
DFG-Phe χ1,χ2 |
DFG-Gly φ,ψ |
ChelixSaltbr_label | Chelix_label | Lys_Glu_dis | Saltbr_label | LysNZ_GluOE_dis | HRD_label | His φ,ψ | Arg φ,ψ | SNC_label | SNCpymol_label | ActLoop_label | ActLoopNT_label | DFG6_XHRD_dis | ActLoopCT_label | APEtype | APEdihe_label | APEdist_label | APE10_dihe_label | APE10 φ,ψ | APE9_dihe_label | APE9 φ,ψ | APE8_dihe_label | APE8 φ,ψ | APE8_rotamer_label | APE8 χ1 | APE67_label | APE6 φ,ψ | APE7 φ,ψ | APE12_dist_label | APE12_DFG4_dis | APE11_dist_label | APE11_DFG4_dis | APE10_dist_label | APE10_DFG4_dis | APE9_dist_label | APE9_Arg_dis | Chain_mut | Chain_phos | Modified_aa | Method | Resolution | Rvalue | FreeRvalue | Chain_id | ChainLen | Ordered_residues | DomainBreak | ActLoopLength | ActLoopResolvedResidues | ActLoopDisorderedResidues | Kinase_domains_Unp | N_Kinase_domains_Unp | pdb | Species | Kincore_name | hmm | Evalue | Score | hmmbeg | hmmend | hmmlen | XDFGnum | DFGnum | PHEnum | DFG4num | DFG6num | LYSnum | GLUnum | GLU4num | XHRDnum | ARGnum | HRDnum | HRDaspnum | aFaspnum | APEnum | APE6num | APE7num | APE8num | APE9num | APE10num | APE11num | APE12num | Hinge1num | Protein_name |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| CMGC | CLK1 | CLK1_HUMAN | 5X8IA | P49759 | 154 | 481 | 484.0 | SQZ:501 | Type1 | Active | DFGin | 7.3534 | 13.9989 | BLAminus | -122.66, 172.48 | 71.45, 69.85 | -89.46, 19.16 | 303.2, 86.95 | -71.61, -17.76 | in-in | in | 8.3789 | Saltbr-in | 2.5421 | HRD-in | -68.32, -52.49 | 79.94, -11.57 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8658 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -131.32, 168.72 | APE9-dihe-na | 74.05, 158.08 | APE8-dihe-in | -81.53, 144.19 | APE8-rot-in | 300.53 | APE67-dihe-in | -65.15, -11.28 | -51.71, -50.28 | APE12-dist-in | 13.0833 | APE11-dist-in | 11.6511 | APE10-dist-in | 7.533 | APE9-dist-in | 3.016 | R432A | None | None | XRAY | 1.902 | 0.168 | 0.206 | A | 346.0 | 328.0 | 0 | 25 | 25 | 0 | [[161, 477]] | 1.0 | 5x8i | Homo sapiens | CMGC_CLK1_HUMAN | CMGC | 2.7e-93 | 318.4 | 1.0 | 301.0 | 301.0 | 324 | 325 | 326 | 328 | 330 | 191 | 206 | 210 | 285 | 287 | 286 | 288.0 | 361 | 349 | 344 | 343 | 342 | 341 | 340 | 339 | 338 | 242 | Dual specificity protein kinase CLK1 |
| CMGC | CLK1 | CLK1_HUMAN | 5X8IB | P49759 | 155 | 481 | 484.0 | SQZ:501 | Type1 | Active | DFGin | 7.3842 | 13.9802 | BLAminus | -126.45, 170.69 | 71.83, 69.37 | -88.36, 11.76 | 302.43, 89.48 | -69.31, -18.97 | in-in | in | 8.3824 | Saltbr-in | 2.41 | HRD-in | -67.27, -52.41 | 79.09, -12.7 | in-in-in | SNCiii | in-in | ActLoopNT-in | 2.8887 | ActLoopCT-in | nonTYR | APEdihe_aaiii | APEdist_iiii | APE10-dihe-na | -130.02, 169.54 | APE9-dihe-na | 72.76, 157.49 | APE8-dihe-in | -80.25, 143.44 | APE8-rot-in | 301.33 | APE67-dihe-in | -65.52, -10.3 | -49.82, -50.77 | APE12-dist-in | 13.1161 | APE11-dist-in | 11.6767 | APE10-dist-in | 7.4994 | APE9-dist-in | 3.0166 | R432A | None | None | XRAY | 1.902 | 0.168 | 0.206 | B | 346.0 | 327.0 | 0 | 25 | 25 | 0 | [[161, 477]] | 1.0 | 5x8i | Homo sapiens | CMGC_CLK1_HUMAN | CMGC | 2.7e-93 | 318.4 | 1.0 | 301.0 | 301.0 | 324 | 325 | 326 | 328 | 330 | 191 | 206 | 210 | 285 | 287 | 286 | 288.0 | 361 | 349 | 344 | 343 | 342 | 341 | 340 | 339 | 338 | 242 | Dual specificity protein kinase CLK1 |
| Spatial label | Dihedral label | Number of Chains | Percent | Representative |
|---|
| Group | Gene | SwissprotID | PDB | UniprotID | First_obs_res | Last_obs_res | Length_Unp | Ligand | Ligand_type | Activity_label | Spatial_label | Phe_Glu4_dis | Phe_Lys_dis | Dihedral_label | XDFG φ,ψ |
DFG-Asp φ,ψ |
DFG-Phe φ,ψ |
DFG-Phe χ1,χ2 |
DFG-Gly φ,ψ |
ChelixSaltbr_label | Chelix_label | Lys_Glu_dis | Saltbr_label | LysNZ_GluOE_dis | HRD_label | His φ,ψ | Arg φ,ψ | SNC_label | SNCpymol_label | ActLoop_label | ActLoopNT_label | DFG6_XHRD_dis | ActLoopCT_label | APEtype | APEdihe_label | APEdist_label | APE10_dihe_label | APE10 φ,ψ | APE9_dihe_label | APE9 φ,ψ | APE8_dihe_label | APE8 φ,ψ | APE8_rotamer_label | APE8 χ1 | APE67_label | APE6 φ,ψ | APE7 φ,ψ | APE12_dist_label | APE12_DFG4_dis | APE11_dist_label | APE11_DFG4_dis | APE10_dist_label | APE10_DFG4_dis | APE9_dist_label | APE9_Arg_dis | Chain_mut | Chain_phos | Modified_aa | Method | Resolution | Rvalue | FreeRvalue | Chain_id | ChainLen | Ordered_residues | DomainBreak | ActLoopLength | ActLoopResolvedResidues | ActLoopDisorderedResidues | Kinase_domains_Unp | N_Kinase_domains_Unp | pdb | Species | Kincore_name | hmm | Evalue | Score | hmmbeg | hmmend | hmmlen | XDFGnum | DFGnum | PHEnum | DFG4num | DFG6num | LYSnum | GLUnum | GLU4num | XHRDnum | ARGnum | HRDnum | HRDaspnum | aFaspnum | APEnum | APE6num | APE7num | APE8num | APE9num | APE10num | APE11num | APE12num | Hinge1num | Protein_name |
|---|